CID 46864104

Tert-butyl n-[1-(aminomethyl)cyclopropyl]carbamate

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CC(C)(C)OC(=O)NC1(CC1)CN
InChI
InChI=1S/C9H18N2O2/c1-8(2,3)13-7(12)11-9(6-10)4-5-9/h4-6,10H2,1-3H3,(H,11,12)
InChIKey
RPSISDKVKZYNRL-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(aminomethyl)cyclopropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

180
Patents

186.13683 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.144106 141.4
[M+Na]+ 209.126048 149.0
[M-H]- 185.129554 145.7
[M+NH4]+ 204.170653 157.7
[M+K]+ 225.099988 147.9
[M+H-H2O]+ 169.134090 137.1
[M+HCOO]- 231.135031 163.8
[M+CH3COO]- 245.150681 188.6
[M+Na-2H]- 207.111496 147.8
[M]+ 186.13628142 143.9
[M]- 186.13737858 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe